SCHEMBL19133992

SCHEMBL19133992

COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(C(N)CCNC(=O)OC(C)(C)C)cc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASR P41180 3/20 0.37
UTS2R Q9UKP6 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
TDP1 Q9NUW8 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
CASP1 P29466 1/20 0.33
BACE1 P56817 1/20 0.33
KMT2A Q03164 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CDK2 P24941 1/20 0.32
NAMPT P43490 1/20 0.32
ALDH1A1 P00352 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2121943 0.95 CASR (0.35) CASRUTS2RDDB1CRBNTDP1
SCHEMBL19133984 0.95 CASR (0.35) CASRUTS2RDDB1CRBNTDP1
SCHEMBL19133980 0.93 CASR (0.41) CASRTDP1KMT2ANPC1RAB9A
SCHEMBL479566 0.90 CASR (0.40) CASRTDP1L3MBTL1TP53POLB
SCHEMBL19133982 0.89 MAPT (0.41) CASRTDP1KMT2ANPC1RAB9A
SCHEMBL3844906 0.87 KMT2A (0.39) DDB1CRBNTDP1L3MBTL1TP53
SCHEMBL2117916 0.87 RAB9A (0.38) CASRTDP1L3MBTL1TP53POLB
SCHEMBL479599 0.87 TP53 (0.36) CASRTDP1L3MBTL1TP53POLB
SCHEMBL480691 0.86 RAB9A (0.37) CASRTDP1L3MBTL1TP53POLB
SCHEMBL480642 0.86 KMT2A (0.39) CASRTDP1L3MBTL1TP53POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411034-B1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS LIFE & BRAIN GMBH (DE) 2017-07-26 EP disclosed